SCHEMBL22659232

SCHEMBL22659232

Cc1ccccc1-c1cc(N)n(C(C)C)n1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE1A P54750 5/20 0.41
PDE1B Q01064 5/20 0.41
PDE1C Q14123 5/20 0.41
MAPT P10636 5/20 0.40
ALDH1A1 P00352 4/20 0.40
RAB9A P51151 4/20 0.40
SMN1; SMN2 Q16637 4/20 0.40
NPC1 O15118 3/20 0.40
HPGD P15428 3/20 0.40
MEN1 O00255 2/20 0.40
KMT2A Q03164 2/20 0.40
KDM4E B2RXH2 1/20 0.40
APAF1 O14727 1/20 0.40
TDP2 O95551 1/20 0.40
LMNA P02545 1/20 0.40
PKM P14618 1/20 0.40
MAOB P27338 1/20 0.40
HTT P42858 1/20 0.40
PTGS2 P35354 1/20 0.39
IDO1 P14902 1/20 0.37

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
SCHEMBL23399729 0.81 CYP1A2 (0.41) PDE1APDE1BPDE1CMAPTALDH1A1
SCHEMBL29406288 0.80 MAPT (0.43) MAPTALDH1A1RAB9ASMN1; SMN2NPC1
SCHEMBL13974491 0.80 MAPT (0.43) MAPTALDH1A1RAB9ASMN1; SMN2NPC1
SCHEMBL22659757 0.79 HSD11B1 (0.42) CYP1A2CYP2C19CYP3A4TLR8ALOX5AP
SCHEMBL17619611 0.78 SMN1; SMN2 (0.50) PDE1APDE1BPDE1CMAPTALDH1A1
SCHEMBL10103967 0.73 SMN1; SMN2 (0.58) MAPTALDH1A1RAB9ASMN1; SMN2NPC1
SCHEMBL2683566 0.70 KDR (0.48) MAPTALDH1A1RAB9ASMN1; SMN2NPC1
SCHEMBL10103716 0.70 RET (0.46) MAPTALDH1A1RAB9ASMN1; SMN2NPC1
SCHEMBL4664677 0.70 MAPT (0.47) MAPTALDH1A1RAB9ASMN1; SMN2NPC1
SCHEMBL691317 0.69 POLB (0.44) PDE1APDE1BPDE1CMAPTALDH1A1

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-12312337-B2 Compounds and methods for treating cancer ANTIDOTE IP HOLDINGS, LLC (US) 2025-05-27 US disclosed
US-20220204482-A1 COMPOUNDS AND METHODS FOR TREATING CANCER ANTIDOTE IP HOLDINGS, LLC 2022-06-30 US disclosed
EP-3966208-A2 COMPOUNDS AND METHODS FOR TREATING CANCER Antidote IP Holdings, LLC (US) 2022-03-16 EP disclosed
WO-2020231739-A2 COMPOUNDS AND METHODS FOR TREATING CANCER ANTIDOTE IP HOLDINGS, LLC (US) 2020-11-19 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-20220204482-A1 COMPOUNDS AND METHODS FOR TREATING CANCER AHR, ARNT, HMOX1 PDE1A 3767/4885PDE1B 3896/4885PDE1C 4399/4885
US-12312337-B2 Compounds and methods for treating cancer AHR, ARNT, HMOX1 PDE1A 3767/4885PDE1B 3896/4885PDE1C 4399/4885

“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.