SCHEMBL6561248

SCHEMBL6561248

CCCNCCc1cccs1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TAAR1 Q96RJ0 2/20 0.48
NPC1 O15118 4/20 0.47
RAB9A P51151 4/20 0.47
SMN1; SMN2 Q16637 4/20 0.47
ALDH1A1 P00352 1/20 0.46
MAPT P10636 1/20 0.46
KMT2A Q03164 2/20 0.45
MEN1 O00255 1/20 0.45
MAOB P27338 1/20 0.44
ADAM17 P78536 1/20 0.42
DRD2 P14416 1/20 0.42
DRD3 P35462 1/20 0.42
GPR84 Q9NQS5 1/20 0.42
PTGS1 P23219 1/20 0.41
PTGS2 P35354 1/20 0.41
FLT3 P36888 1/20 0.41
ADRA2A P08913 1/20 0.41
ADRA2B P18089 1/20 0.41
ADRA2C P18825 1/20 0.41
BRD4 O60885 1/20 0.40

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL10484395 0.90 TAAR1 (0.58) TAAR1NPC1RAB9ASMN1; SMN2KMT2A
SCHEMBL5242878 0.89 SMN1; SMN2 (0.50) TAAR1NPC1RAB9ASMN1; SMN2ALDH1A1
SCHEMBL22067943 0.89 TAAR1 (0.50) TAAR1NPC1RAB9ASMN1; SMN2ALDH1A1
Hydrochloric Acid SCHEMBL10484340 0.88 TAAR1 (0.56) TAAR1NPC1RAB9ASMN1; SMN2ALDH1A1
SCHEMBL13290402 0.86 TAAR1 (0.50) TAAR1NPC1RAB9ASMN1; SMN2ALDH1A1
SCHEMBL7904758 0.86 SIGMAR1 (0.53) TAAR1NPC1RAB9ASMN1; SMN2ALDH1A1
SCHEMBL11922708 0.82 KMT2A (0.59) SMN1; SMN2ALDH1A1MAPTKMT2AMEN1
SCHEMBL20689749 0.82 MAOB (0.57) TAAR1NPC1RAB9ASMN1; SMN2MAOB
SCHEMBL4095146 0.80 TAAR1 (0.44) TAAR1NPC1RAB9ASMN1; SMN2KMT2A
SCHEMBL10962630 0.80 MAOB (0.59) TAAR1NPC1RAB9ASMN1; SMN2ALDH1A1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 71 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11802274-B2 Engineered imine reductases and methods for the reductive amination of ketone and amine compounds CODEXIS, INC. (US) 2023-10-31 US disclosed
US-11802274-B2 Engineered imine reductases and methods for the reductive amination of ketone and amine compounds CODEXIS, INC. (US) 2023-10-31 US disclosed
US-20230295673-A1 ENGINEERED IMINE REDUCTASES AND METHODS FOR THE REDUCTIVE AMINATION OF KETONE AND AMINE COMPOUNDS INNOVATUS LIFE SCIENCES LENDING FUND I, LP, AS COLLATERAL AGENT 2023-09-21 US disclosed
US-20230295673-A1 ENGINEERED IMINE REDUCTASES AND METHODS FOR THE REDUCTIVE AMINATION OF KETONE AND AMINE COMPOUNDS INNOVATUS LIFE SCIENCES LENDING FUND I, LP, AS COLLATERAL AGENT 2023-09-21 US disclosed
US-20220315961-A1 ENGINEERED IMINE REDUCTASES AND METHODS FOR THE REDUCTIVE AMINATION OF KETONE AND AMINE COMPOUNDS INNOVATUS LIFE SCIENCES LENDING FUND I, LP, AS COLLATERAL AGENT 2022-10-06 US disclosed
US-11377673-B2 Engineered imine reductases and methods for the reductive amination of ketone and amine compounds CODEXIS, INC. (US) 2022-07-05 US disclosed
US-11352609-B2 Engineered imine reductases and methods for the reductive amination of ketone and amine compounds CODEXIS, INC. (US) 2022-06-07 US disclosed
US-20210301266-A1 ENGINEERED IMINE REDUCTASES AND METHODS FOR THE REDUCTIVE AMINATION OF KETONE AND AMINE COMPOUNDS INNOVATUS LIFE SCIENCES LENDING FUND I, LP, AS COLLATERAL AGENT 2021-09-30 US disclosed
US-11060072-B2 Engineered imine reductases and methods for the reductive amination of ketone and amine compounds CODEXIS, INC. (US) 2021-07-13 US disclosed
US-10947572-B2 Engineered imine reductases and methods for the reductive amination of ketone and amine compounds CODEXIS, INC. (US) 2021-03-16 US disclosed
US-20150132807-A1 ENGINEERED IMINE REDUCTASES AND METHODS FOR THE REDUCTIVE AMINATION OF KETONE AND AMINE COMPOUNDS INNOVATUS LIFE SCIENCES LENDING FUND I, LP, AS COLLATERAL AGENT 2015-05-14 US disclosed
US-20150132807-A1 ENGINEERED IMINE REDUCTASES AND METHODS FOR THE REDUCTIVE AMINATION OF KETONE AND AMINE COMPOUNDS INNOVATUS LIFE SCIENCES LENDING FUND I, LP, AS COLLATERAL AGENT 2015-05-14 US disclosed
US-20130302859-A1 Engineered imine reductases and methods for the reductive animation of ketone and amine compounds. CODEXIS,INC. (US) 2013-11-14 US disclosed
US-20130302859-A1 Engineered imine reductases and methods for the reductive animation of ketone and amine compounds. CODEXIS,INC. (US) 2013-11-14 US disclosed
WO-2010035111-A1 A PROCESS FOR THE PREPARATION OF ROTIGOTINE FIDIA FARMACEUTICI S.P.A. (IT) 2010-04-01 WO disclosed
WO-2009063170-A1 PREPARATION OF CRYSTALLINE ROTIGOTINE BASE PLIVA HRVATSKA D.O.O. (HR) 2009-05-22 WO disclosed
EP-1091946-B1 NEW 2-AMINOTHIAZOL-FUSED 2-AMINOINDANS AND 2-AMINOTETRALINS AND THEIR USE WIKSTROEM HAKAN VILHELM (NL) 2004-03-17 EP disclosed
US-6291494-B1 2-aminothiazol-fused 2-aminoindans and 2-aminotetralins and their use ASTRAZENECA AB (SE) 2001-09-18 US disclosed
EP-1091946-A1 NEW 2-AMINOTHIAZOL-FUSED 2-AMINOINDANS AND 2-AMINOTETRALINS AND THEIR USE WIKSTRÖM, Hakan Vilhelm (NL) 2001-04-18 EP disclosed
WO-2000001680-A1 NEW 2-AMINOTHIAZOL-FUSED 2-AMINOINDANS AND 2-AMINOTETRALINS AND THEIR USE WIKSTROEM HAKAN VILHELM (NL) 2000-01-13 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-11352609-B2 Engineered imine reductases and methods for the reductive amination of ketone and amine compounds AKR1C4, AKR7A2, AKR1C2 TAAR1 517/4885NPC1 3962/4885RAB9A 4226/4885
US-11802274-B2 Engineered imine reductases and methods for the reductive amination of ketone and amine compounds AKR1C4, AKR7A2, AKR1C2 TAAR1 517/4885NPC1 3962/4885RAB9A 4226/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.