SCHEMBL30150849

SCHEMBL30150849

c1ccc(C2CCCN2C2CC3(CCNCC3)C2)c(C2CC2)c1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
OPRM1 P35372 2/20 0.37
OPRK1 P41145 2/20 0.37
USP2 O75604 5/20 0.36
CYP2C19 P33261 3/20 0.36
CYP2C9 P11712 3/20 0.36
CYP2D6 P10635 5/20 0.36
CYP3A4 P08684 3/20 0.36
CYP1A2 P05177 2/20 0.36
TP53 P04637 1/20 0.36
ALOX15 P16050 1/20 0.36
TSHR P16473 3/20 0.35
ALDH1A1 P00352 2/20 0.35
HTR2C P28335 3/20 0.34
HTR1A P08908 1/20 0.34
SLC6A2 P23975 1/20 0.34
SLC6A4 P31645 1/20 0.34
HTR2A P28223 1/20 0.34
HTR2B P41595 1/20 0.34
KMT2A Q03164 2/20 0.33
MEN1 O00255 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
SCHEMBL23579330 1.00 OPRM1 (0.37) OPRM1OPRK1USP2CYP2C19CYP2C9
SCHEMBL23578824 1.00 OPRM1 (0.37) OPRM1OPRK1USP2CYP2C19CYP2C9
SCHEMBL29747612 1.00 OPRM1 (0.37) OPRM1OPRK1USP2CYP2C19CYP2C9
SCHEMBL26647925 0.87 OPRM1 (0.39) OPRM1OPRK1
SCHEMBL26647933 0.87 OPRM1 (0.39) OPRM1OPRK1
SCHEMBL30078385 0.86 HTR2C (0.42) USP2CYP2C19CYP2D6CYP3A4TSHR
SCHEMBL26779745 0.84 HTR2C (0.46) OPRM1OPRK1HTR2CHTR1ASLC6A2
SCHEMBL29855569 0.84 OPRM1 (0.36) OPRM1OPRK1CYP2C19CYP2C9CYP3A4
SCHEMBL23323222 0.83 BCL2 (0.33) USP2CYP2C19CYP2C9CYP2D6CYP3A4
SCHEMBL30895235 0.83 HTR2C (0.36) OPRM1OPRK1USP2CYP2C19CYP2D6

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-12552784-B2 1H-pyrrolo[2,3-b]pyridine derivatives as BCL-2 inhibitors for the treatment of neoplastic and autoimmune diseases NEWAVE PHARMACEUTICAL INC. (US) 2026-02-17 US disclosed
US-12077536-B2 BCL-2 inhibitors BEIGENE, LTD. (KY) 2024-09-03 US disclosed
US-20230119463-A1 1H-PYRROLO[2,3-B]PYRIDINE DERIVATIVES AS BCL-2 INHIBITORS FOR THE TREATMENT OF NEOPLASTIC AND AUTOIMMUNE DISEASES NEWAVE PHARMACEUTICAL INC. 2023-04-20 US disclosed
US-20220402915-A1 BCL-2 INHIBITORS BEONE MEDICINES I GMBH (CH) 2022-12-22 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 (4 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-20230119463-A1 1H-PYRROLO[2,3-B]PYRIDINE DERIVATIVES AS BCL-2 INHIBITORS FOR THE TREATMENT OF NEOPLASTIC AND AUTOIMMUNE DISEASES BCL2, BAK1, BCL2A1 OPRM1 4776/4885OPRK1 4172/4885USP2 1306/4885
US-20220402915-A1 BCL-2 INHIBITORS BCL2, BCL2L1, BCL2L2 OPRM1 4833/4885OPRK1 4318/4885USP2 540/4885
US-12077536-B2 BCL-2 inhibitors BCL2, BCL2L1, BCL2L2 OPRM1 4833/4885OPRK1 4318/4885USP2 540/4885
US-12552784-B2 1H-pyrrolo[2,3-b]pyridine derivatives as BCL-2 inhibitors for the treatment of neoplastic and autoimmune diseases BCL3, BCL2A1, BCL6 OPRM1 1881/4885OPRK1 1384/4885USP2 3608/4885

“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.