SCHEMBL17367234

SCHEMBL17367234

CC1(C)c2ccccc2-c2oc3ccccc3c21

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NTRK1 P04629 1/20 0.39
PLK3 Q9H4B4 1/20 0.39
KDM4E B2RXH2 4/20 0.37
CYP3A4 P08684 3/20 0.37
HSD17B10 Q99714 3/20 0.37
CYP2C19 P33261 2/20 0.37
MEN1 O00255 2/20 0.37
KMT2A Q03164 2/20 0.37
ALDH1A1 P00352 2/20 0.37
HPGD P15428 2/20 0.37
TSHR P16473 2/20 0.37
CYP2C9 P11712 1/20 0.37
NMUR2 Q9GZQ4 2/20 0.36
L3MBTL1 Q9Y468 3/20 0.35
BRD4 O60885 1/20 0.34
CREBBP Q92793 1/20 0.34
GLA P06280 1/20 0.34
MAPT P10636 1/20 0.34
PGAM1 P18669 1/20 0.34
MAOA P21397 1/20 0.34

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
SCHEMBL18506101 0.86 NQO1 (0.37) NTRK1PLK3KDM4ECYP3A4HSD17B10
SCHEMBL23593240 0.82 AHR (0.45) MEN1KMT2AALDH1A1NMUR2MAOA
SCHEMBL23592372 0.82 AHR (0.45) MEN1KMT2AALDH1A1NMUR2SMN1; SMN2
SCHEMBL20174739 0.81 NTRK1 (0.40) NTRK1PLK3KDM4ECYP3A4HSD17B10
SCHEMBL19887080 0.80 ABCG2 (0.40) KDM4ECYP3A4CYP2C19MEN1KMT2A
SCHEMBL23592374 0.79 NMUR2 (0.45) NTRK1PLK3KDM4ECYP3A4HSD17B10
SCHEMBL23592288 0.79 PDK2 (0.35) ABCG2
SCHEMBL23592290 0.79 PDK2 (0.32)
SCHEMBL17367233 0.78 CRHBP (0.32)
SCHEMBL23593238 0.78 NMUR2 (0.38) NTRK1PLK3KDM4ECYP3A4HSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10749118-B2 Heterocyclic compound and organic light-emitting device including the same SAMSUNG DISPLAY CO., LTD. (KR) 2020-08-18 US disclosed
US-20180053902-A1 COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME SAMSUNG DISPLAY CO., LTD. (KR) 2018-02-22 US disclosed
US-20150380663-A1 HETEROCYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME SAMSUNG DISPLAY CO., LTD. (KR) 2015-12-31 US disclosed
US-20150380663-A1 HETEROCYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME SAMSUNG DISPLAY CO., LTD. (KR) 2015-12-31 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-20180053902-A1 COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME OCIAD1, OXA1L, CYP1B1 NTRK1 4593/4885PLK3 3640/4885KDM4E 3182/4885
US-20150380663-A1 HETEROCYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME CYP1A1, CRY1, CYP1B1 NTRK1 4662/4885PLK3 4477/4885KDM4E 3404/4885
US-10749118-B2 Heterocyclic compound and organic light-emitting device including the same CYP1A1, CRY1, CYP1B1 NTRK1 4662/4885PLK3 4477/4885KDM4E 3404/4885

“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.