SCHEMBL17907902

SCHEMBL17907902

CC(O)(CSc1ccccc1)c1cc2nc(C(F)(F)F)ccc2[nH]1

nearest known ligand 0.60

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 2/20 0.39
RAB9A P51151 2/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
CYP1A2 P05177 1/20 0.39
CYP3A4 P08684 1/20 0.39
CYP2D6 P10635 1/20 0.39
CYP2C9 P11712 1/20 0.39
CYP2C19 P33261 1/20 0.39
MDM4 O15151 1/20 0.34
TP53 P04637 1/20 0.34
MDM2 Q00987 1/20 0.34
ALDH1A1 P00352 2/20 0.33
HPGD P15428 2/20 0.33
MEN1 O00255 1/20 0.33
MAPT P10636 1/20 0.33
KMT2A Q03164 1/20 0.33

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
SCHEMBL17907900 0.90 TP53 (0.33) SMN1; SMN2TP53MEN1MAPTKMT2A
SCHEMBL17907901 0.89 MEN1 (0.39) NPC1RAB9AMEN1KMT2A
SCHEMBL17907903 0.78 TRPV1 (0.33)
SCHEMBL26265751 0.75 MAPT (0.36) NPC1RAB9ASMN1; SMN2CYP1A2CYP2C9
SCHEMBL978460 0.69 MEN1 (0.45) NPC1RAB9ACYP1A2CYP2C9CYP2C19
SCHEMBL26423009 0.66 BRD4 (0.41) NPC1RAB9ACYP1A2CYP2C9CYP2C19
SCHEMBL979841 0.65 AR (0.54)
SCHEMBL30189253 0.65 KDM4E (0.47) SMN1; SMN2CYP1A2CYP2C19ALDH1A1HPGD
SCHEMBL831575 0.65 KDM4E (0.47) SMN1; SMN2CYP1A2CYP2C19ALDH1A1HPGD
SCHEMBL19663767 0.65 ALDH1A1 (0.35) SMN1; SMN2CYP1A2CYP2C9CYP2C19ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1756109-B1 NOVEL INDOLE DERIVATIVES AS SELECTIVE ANDROGEN RECEPTOR MODULATORS (SARMS) JANSSEN PHARMACEUTICA NV (BE) 2016-07-13 EP claimed
US-11826430-B2 Anti-cancer nuclear hormone receptor-targeting compounds NUVATION BIO INC. (US) 2023-11-28 US disclosed
US-11826430-B2 Anti-cancer nuclear hormone receptor-targeting compounds NUVATION BIO INC. (US) 2023-11-28 US disclosed
US-20210214316-A1 ANTI-CANCER NUCLEAR HORMONE RECEPTOR-TARGETING COMPOUNDS SAGARD HOLDINGS MANAGER LP, AS ADMINISTRATIVE AGENT (CA) 2021-07-15 US disclosed
WO-2021097046-A1 ANTI-CANCER NUCLEAR HORMONE RECEPTOR-TARGETING COMPOUNDS NUVATION BIO INC. (US) 2021-05-20 WO disclosed
US-20200360523-A1 ANTI-CANCER NUCLEAR HORMONE RECEPTOR-TARGETING COMPOUNDS SAGARD HOLDINGS MANAGER LP, AS ADMINISTRATIVE AGENT (CA) 2020-11-19 US disclosed
EP-1756109-B1 NOVEL INDOLE DERIVATIVES AS SELECTIVE ANDROGEN RECEPTOR MODULATORS (SARMS) JANSSEN PHARMACEUTICA NV (BE) 2016-07-13 EP 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-20210214316-A1 ANTI-CANCER NUCLEAR HORMONE RECEPTOR-TARGETING COMPOUNDS NCOA1, NCOR1, NCOA3 NPC1 518/4885RAB9A 3588/4885SMN1; SMN2 4588/4885
US-20200360523-A1 ANTI-CANCER NUCLEAR HORMONE RECEPTOR-TARGETING COMPOUNDS NCOA1, NCOR1, NCOA3 NPC1 518/4885RAB9A 3588/4885SMN1; SMN2 4588/4885
US-11826430-B2 Anti-cancer nuclear hormone receptor-targeting compounds NCOA1, NCOR1, NCOA3 NPC1 518/4885RAB9A 3588/4885SMN1; SMN2 4588/4885

“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.