SCHEMBL10310299

SCHEMBL10310299

N=C(N)NCc1ccccc1F

nearest known ligand 0.50

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
RIPK1 Q13546 1/20 0.49
KMT2A Q03164 4/20 0.47
MEN1 O00255 3/20 0.47
HPGD P15428 3/20 0.47
LMNA P02545 2/20 0.47
SMN1; SMN2 Q16637 2/20 0.46
MAPT P10636 2/20 0.46
PKM P14618 1/20 0.46
CRHBP P24387 1/20 0.46
CRHR2 Q13324 1/20 0.46
ALDH1A1 P00352 2/20 0.46
PPIA P62937 1/20 0.45
TAAR1 Q96RJ0 1/20 0.45
MPO P05164 1/20 0.45
TSHR P16473 1/20 0.44

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
SCHEMBL31344502 1.00 RIPK1 (0.49) RIPK1KMT2AMEN1HPGDLMNA
SCHEMBL17198941 0.86 RIPK1 (0.44) RIPK1KMT2AMEN1HPGDLMNA
Hydrochloric Acid SCHEMBL30496712 0.84 RIPK1 (0.43) RIPK1KMT2AMEN1HPGDLMNA
Hydrochloric Acid SCHEMBL8004974 0.82 PPIA (0.51) RIPK1KMT2AMEN1HPGDSMN1; SMN2
SCHEMBL3916714 0.81 TAAR1 (0.55) KMT2AMEN1HPGDALDH1A1TAAR1
SCHEMBL22319029 0.81 ALDH1A1 (0.47) RIPK1KMT2AMEN1HPGDLMNA
SCHEMBL30496749 0.81 TAAR1 (0.55) KMT2AMEN1HPGDALDH1A1TAAR1
SCHEMBL5532672 0.81 KMT2A (0.55) RIPK1KMT2AMEN1HPGDLMNA
SCHEMBL5527359 0.81 ALDH1A1 (0.59) RIPK1KMT2AMEN1HPGDLMNA
Hydrochloric Acid SCHEMBL28482472 0.80 TAAR1 (0.53) KMT2AMEN1HPGDALDH1A1TAAR1

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 13 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3218333-B1 FLUORIDE TRAPPING ARRANGEMENT GE HEALTHCARE LTD (GB) 2023-06-07 EP claimed
EP-2948188-A1 NEURONAL IMAGING AND TREATMENT Tylerton International Holdings Inc. (VG) 2015-12-02 EP disclosed
EP-1799684-B1 LACTAM COMPOUNDS USEFUL AS PROTEIN KINASE INHIBITORS MILLENNIUM PHARM INC (US) 2014-12-03 EP disclosed
WO-2014115152-A1 NEURONAL IMAGING AND TREATMENT TYLERTON INTERNATIONAL HOLDINGS INC. (VG) 2014-07-31 WO disclosed
US-20120178739-A1 LACTAM COMPOUNDS USEFUL AS PROTEIN KINASE INHIBITORS MILLENNIUM PHARMACEUTICALS, INC. (US) 2012-07-12 US disclosed
US-20120178739-A1 LACTAM COMPOUNDS USEFUL AS PROTEIN KINASE INHIBITORS MILLENNIUM PHARMACEUTICALS, INC. (US) 2012-07-12 US disclosed
US-20110039820-A1 LACTAM COMPOUNDS USEFUL AS PROTEIN KINASE INHIBITORS MILLENNIUM PHARMACEUTICALS, INC. (US) 2011-02-17 US disclosed
US-20110039820-A1 LACTAM COMPOUNDS USEFUL AS PROTEIN KINASE INHIBITORS MILLENNIUM PHARMACEUTICALS, INC. (US) 2011-02-17 US disclosed
US-20090105213-A1 Lactam compounds useful as protein kinase inhibitors MILLENNIUM PHARMACEUTICALS, INC. (US) 2009-04-23 US disclosed
US-20090105213-A1 Lactam compounds useful as protein kinase inhibitors MILLENNIUM PHARMACEUTICALS, INC. (US) 2009-04-23 US disclosed
US-7459448-B2 Lactam compounds useful as protein kinase inhibitors MILLENNIUM PHARMACEUTICALS, INC. (US) 2008-12-02 US disclosed
US-7459448-B2 Lactam compounds useful as protein kinase inhibitors MILLENNIUM PHARMACEUTICALS, INC. (US) 2008-12-02 US disclosed
US-7429565-B2 Antiviral phosphonate analogs GILEAD SCIENCES, INC. (US) 2008-09-30 US 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 (3 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-20120178739-A1 LACTAM COMPOUNDS USEFUL AS PROTEIN KINASE INHIBITORS PRKCI, PIK3CA, AKT1 RIPK1 197/4885KMT2A 2007/4885MEN1 1532/4885
US-20090105213-A1 Lactam compounds useful as protein kinase inhibitors PRKCI, PIK3CA, AKT1 RIPK1 197/4885KMT2A 2007/4885MEN1 1532/4885
US-20110039820-A1 LACTAM COMPOUNDS USEFUL AS PROTEIN KINASE INHIBITORS PRKCI, PIK3CA, AKT1 RIPK1 197/4885KMT2A 2007/4885MEN1 1532/4885

“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.