SCHEMBL2609367

SCHEMBL2609367

CC(C)c1ccc(-c2ccc(Cl)cc2)cn1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LTA4H P09960 1/20 0.43
NPSR1 Q6W5P4 1/20 0.41
MAP4K4 O95819 3/20 0.41
MAPT P10636 3/20 0.40
ALDH1A1 P00352 1/20 0.40
LMNA P02545 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
NPC1 O15118 4/20 0.40
RAB9A P51151 4/20 0.40
SMN1; SMN2 Q16637 4/20 0.40
KMT2A Q03164 3/20 0.40
MEN1 O00255 2/20 0.40
GAA P10253 1/20 0.40
CYP1A2 P05177 4/20 0.39
CYP3A4 P08684 2/20 0.39
CYP2C19 P33261 2/20 0.39
EGLN1 Q9GZT9 1/20 0.38
CCNB2 O95067 1/20 0.38
CDK1 P06493 1/20 0.38
CCNB1 P14635 1/20 0.38

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
SCHEMBL888893 0.87 CHRNA7 (0.36) MAPTALDH1A1NPC1RAB9ASMN1; SMN2
SCHEMBL889387 0.86 EGLN1 (0.44) NPSR1MAPTALDH1A1LMNANPC1
Hydrochloric Acid SCHEMBL22158846 0.83 ADRB2 (0.44) LTA4HNPSR1MAP4K4MAPTALDH1A1
Hydrochloric Acid SCHEMBL22158848 0.83 ADRB2 (0.44) LTA4HNPSR1MAP4K4MAPTALDH1A1
SCHEMBL2609315 0.83 PTK2 (0.38) TDP1L3MBTL1MAPK1
SCHEMBL5018725 0.82 NPC1 (0.45) MAPTALDH1A1NPC1RAB9ASMN1; SMN2
SCHEMBL890116 0.82 NPC1 (0.39) NPSR1MAP4K4MAPTALDH1A1LMNA
SCHEMBL2609349 0.80 CNR2 (0.47) MAP4K4MAPTLMNANPC1RAB9A
SCHEMBL26213090 0.80 MKNK1 (0.44)
SCHEMBL22184930 0.80 GPR55 (0.40) CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8785445-B2 7-phenoxychroman carboxylic acid derivatives ARRAY BIOPHARMA INC. (US) 2014-07-22 US disclosed
US-20120101103-A1 7-PHENOXYCHROMAN CARBOXYLIC ACID DERIVATIVES ARRAY BIOPHARMA INC. (US) 2012-04-26 US disclosed
US-20120101103-A1 7-PHENOXYCHROMAN CARBOXYLIC ACID DERIVATIVES ARRAY BIOPHARMA INC. (US) 2012-04-26 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 (1 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-20120101103-A1 7-PHENOXYCHROMAN CARBOXYLIC ACID DERIVATIVES PTGDR2, PTGDR, HRH2 LTA4H 66/4885NPSR1 968/4885MAP4K4 1593/4885

“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.